2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(4-bromophenyl)ethanamide

Systemtic Name: 2-[[4-(1-adamantyl)phenyl]-methylsulfonyl-amino]-N-(4-bromophenyl)ethanamide Openeye Name: 2-[4-(1-adamantyl)-N-methylsulfonyl-anilino]-N-(4-bromophenyl)acetamide CAS Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(4-bromophenyl)acetamide IUPAC Name: 2-[4-(1-adamantyl)-N-methylsulfonylanilino]-N-(4-bromophenyl)acetamide Traditional Name: 2-[4-(1-adamantyl)-N-mesyl-anilino]-N-(4-bromophenyl)acetamide Formula: C25H29BrN2O3S MolecularWeight: 517.47836

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)Br)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CS(=O)(=O)N(CC(=O)NC1=CC=C(C=C1)Br)C2=CC=C(C=C2)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C25H29BrN2O3S/c1-32(30,31)28(16-24(29)27-22-6-4-21(26)5-7-22)23-8-2-20(3-9-23)25-13-17-10-18(14-25)12-19(11-17)15-25/h2-9,17-19H,10-16H2,1H3,(H,27,29)